vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 01 
  02:17:39 
 
 
  No title
       0
  Normal
  Normal (blocked Davidson)
   F  
       2
       2
       1
     200
       2
      -1
        0.00001000
       -0.02000000
       0
       2
       1
      400.00000000
        1.11000000      0.32000000      0.73000000
  Auto
       1
        0.20000000
       1
   F  
   F  
       1
 
 
  
   
    
            7.66310000       0.00000000       0.00000000 
            0.00000000      19.66310000       0.00000000 
            0.00000000       0.00000000      10.83726000 
    
       1632.96160543 
    
            0.13049549       0.00000000       0.00000000 
            0.00000000       0.05085668       0.00000000 
            0.00000000       0.00000000       0.09227425 
    
   
   
           0.93047548       0.52861433       0.10869202 
           0.85072486       0.23316835       0.42718422 
           0.13672395       0.44832194       0.19562995 
           0.09416170       0.28278593       0.33270815 
           0.81794772       0.33364403       0.02640727 
           0.95647725       0.42165781       0.51728062 
           0.08176361       0.33378269       0.13677854 
           0.19975748       0.40729596       0.39046090 
           0.83024719       0.54582498       0.52150104 
           0.77165405       0.24439877       0.88268358 
           0.05982221       0.51072100       0.65213197 
           0.01346181       0.20575940       0.76127153 
           0.90262525       0.31039357       0.59218149 
           0.86465855       0.44455510       0.95598437 
           0.13776600       0.32393737       0.73659564 
           0.09777691       0.43520936       0.81867469 
           0.42315572       0.46080123       0.12134490 
           0.36384679       0.29230352       0.42118572 
           0.68962675       0.48447381       0.20888029 
           0.64294288       0.31327986       0.34049220 
           0.32528032       0.31787757       0.00948953 
           0.43527768       0.43820019       0.52206870 
           0.56145176       0.34691789       0.14112345 
           0.69207716       0.42937946       0.40032292 
           0.31891740       0.55503200       0.55204815 
           0.27395362       0.23198910       0.86420760 
           0.59941577       0.51715523       0.65649864 
           0.53830108       0.20998320       0.75126482 
           0.39755024       0.32834572       0.62445128 
           0.36799201       0.42698169       0.91920485 
           0.67138846       0.32658829       0.72751301 
           0.63196918       0.43651220       0.81537580 
           0.65779090       0.69469252       0.62457804 
           0.66491609       0.70835318       0.56092143 
           0.45356244       0.57973488       0.67475491 
   
  
  
           1 
           2 
           3 
           4 
           5 
           6 
           7 
           8 
           9 
          10 
          11 
          12 
          13 
          14 
          15 
          16 
          17 
          18 
          19 
          20 
          21 
          22 
          23 
          24 
          25 
          26 
          27 
          28 
          29 
          30 
          31 
          32 
          33 
          34 
          35 
  
 
 
  
          2        1        2 
         0.00000000       0.00000000       0.00000000 
         0.50000000       0.00000000       0.00000000 
         0.00000000       1.00000000       0.00000000 
         0.00000000       0.00000000       0.50000000 
         0.00000000       0.00000000       0.00000000 
  
  
          0.00000000       0.00000000       0.00000000 
          0.50000000       0.00000000       0.00000000 
          0.00000000       0.00000000       0.50000000 
          0.50000000       0.00000000       0.50000000 
  
  
          0.25000000 
          0.25000000 
          0.25000000 
          0.25000000 
  
 
 
  
   No title
    F  
  
  
   normal
       400.00000000
       605.39200000
         0.00001000
       38
       10
      105
       -1
       -1
       136.00000000
        0
        0
        0
        0
         0.00000000
   
         1
          0.20000000
          0.50000000
     T  
     T  
   
   
     T  
         -0.00050000     -0.00050000     -0.00050000
      -100
         2
     F  
   
   
         0
         2
         1
   
   
         2
     F  
          1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
         -1.00000000
     F  
          0.00000000      0.00000000      1.00000000
     F  
          0.00000000      0.00000000      0.00000000
     F  
   
   
     F  
     F  
   
   
       200
        -5
         2
        400.00000000
    
      T  
      F  
           0.00000000
           0.00000002
           0.30000000
          4
           0.40000000
    
   
   
          0.40000000
          1.00000000
          0.10000000
          1.60000000
          1.00000000
    
          4
      F  
        -45
         100.00000000
          1
          1
          5
    
   
   
     F  
     F  
         0
          1.00000000
       -100.00000000   -100.00000000   -100.00000000
          0.00000000
   
  
  
       40
       96
       54
       80
      192
      108
    F  
  
  
        0
       -1
        0
        2
         0.00000000
        -0.02000000
        0
         0.50000000
        -3.00000000
         1.00000000
  
  
         0.00010000
         0.00010000
        1
        1
      256
        16.00000000
  
  
        2
         0.00001000
  
  
        0
         1.11000000      0.32000000      0.73000000
      301
        10.00000000
       -10.00000000
         0.00000000
  
  
        1
    F  
    F  
    F  
    F  
    F  
    F  
    F  
    F  
         0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000
  
  
        3
        4
       -1
    T  
    F  
    F  
    F  
    F  
    F  
  
  
        3
       -1
    F  
        28.08500000      1.00000000     16.00000000
         0.00000000      0.00000000      0.00000000
         1.00000000      1.00000000      1.00000000
    T  
  
   T  
   F  
       0
   F  
       0
  
   --
        1
    F  
   
    F  
    F  
    F  
    F  
    F  
        -1.00000000
        0
        0
         0.00000000
         0.00000000
         0.00000000
         1.00000000
         1.00000000
         1.00000000
         1.00000000
        1
        1
        1
    F  
    F  
    F  
        0
        0
    F  
         0.00000000
         0.00000000
        0
  
  
    F  
        -0.84910000
         0.12340000
         1.00000000
         0.00000000
  
  
        0
        27.99362752
         1.00000000
  
  
    F  
    F  
    F  
    F  
        0
         0.10000000
        -1.00000000
         0.00200000
        -0.10000000
         0.00000000
         0.00000000      0.00000000      0.00000000
         0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000
  
  
    F  
         0.00000000      0.00000000      0.00000000
    T  
    F  
    F  
    F  
    T  
        0
         0.00000000      0.00000000      0.00000000
         0.00000000      0.00000000      0.00000000
  
  
    F  
    F  
    F  
    F  
    T  
        0
       -1     0     0     0
    F  
    F  
    F  
    F  
    F  
    F  
        2
    F  
    F  
    F  
    F  
    F  
    F  
        -2.00000000
        -2.00000000
        -1.00000000
    F  
       -1
         0.00000000
        0
        0
       -1
       -1
       -1
      200
        1
        3
        4
        0
       -30.00000000
       -30.00000000
      -200.00000000
        0
        -0.10000000
    F  
    F  
    F  
    F  
    F  
    F  
    F  
        1
        1
        1
     2800
        0
       -1
       -1
         0.80000001
         1.00000000
  
  
         0.00000000
         0.00000000      0.00000000      0.00000000
         0.00000000
         0.00000000
         0.00000000
  
  
    F  
  
 
 
        35 
         3 
  
   ion
   element
   atomtype
   
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    H    2
    H    2
    O    3
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
      32Si     28.08500000      4.00000000  PAW_PBE Si 05Jan2001                  
       2H       1.00000000      1.00000000  PAW_PBE H 15Jun2001                   
       1O      16.00000000      6.00000000  PAW_PBE O 08Apr2002                   
   
  
 
 
  
   
           7.66310000       0.00000000       0.00000000 
           0.00000000      19.66310000       0.00000000 
           0.00000000       0.00000000      10.83726000 
   
      1632.96160543 
   
           0.13049549       0.00000000       0.00000000 
           0.00000000       0.05085668       0.00000000 
           0.00000000       0.00000000       0.09227425 
   
  
  
          0.93047548       0.52861433       0.10869202 
          0.85072486       0.23316835       0.42718422 
          0.13672395       0.44832194       0.19562995 
          0.09416170       0.28278593       0.33270815 
          0.81794772       0.33364403       0.02640727 
          0.95647725       0.42165781       0.51728062 
          0.08176361       0.33378269       0.13677854 
          0.19975748       0.40729596       0.39046090 
          0.83024719       0.54582498       0.52150104 
          0.77165405       0.24439877       0.88268358 
          0.05982221       0.51072100       0.65213197 
          0.01346181       0.20575940       0.76127153 
          0.90262525       0.31039357       0.59218149 
          0.86465855       0.44455510       0.95598437 
          0.13776600       0.32393737       0.73659564 
          0.09777691       0.43520936       0.81867469 
          0.42315572       0.46080123       0.12134490 
          0.36384679       0.29230352       0.42118572 
          0.68962675       0.48447381       0.20888029 
          0.64294288       0.31327986       0.34049220 
          0.32528032       0.31787757       0.00948953 
          0.43527768       0.43820019       0.52206870 
          0.56145176       0.34691789       0.14112345 
          0.69207716       0.42937946       0.40032292 
          0.31891740       0.55503200       0.55204815 
          0.27395362       0.23198910       0.86420760 
          0.59941577       0.51715523       0.65649864 
          0.53830108       0.20998320       0.75126482 
          0.39755024       0.32834572       0.62445128 
          0.36799201       0.42698169       0.91920485 
          0.67138846       0.32658829       0.72751301 
          0.63196918       0.43651220       0.81537580 
          0.65779090       0.69469252       0.62457804 
          0.66491609       0.70835318       0.56092143 
          0.45356244       0.57973488       0.67475491 
  
 
 
  
      12.50   12.53
      13.85   13.87
   
         24.76344702 
       9010.57469092 
     -12291.51145965 
       -264.10897947 
       3167.08814863 
      -2605.71786812 
         -0.00765596 
       -197.17486615 
       3755.32434067 
        599.22979790 
        599.23745385 
        599.23234988 
   
  
  
      15.63   15.65
      15.63   15.65
   
        -88.96162651 
        -88.95828120 
        -88.96051141 
   
  
  
      14.92   14.94
      14.92   14.94
   
       -162.50555282 
       -162.48005139 
       -162.49705235 
   
  
  
      15.28   15.33
      15.29   15.33
   
       -165.51680590 
       -165.48994158 
       -165.50785113 
   
  
  
      16.17   16.22
      16.39   16.43
   
       -165.66511573 
       -165.63823124 
       -165.65615423 
   
  
  
      14.94   15.02
      16.53   16.61
   
      -5784.88435989 
      -5784.85562541 
      -5784.87478173 
   
  
  
      12.96   13.00
      13.78   13.82
   
       -113.87677866 
       -113.88862774 
       -113.88072836 
   
  
  
      15.93   15.96
      16.82   16.85
   
       -136.47189448 
       -136.46994182 
       -136.47124360